SCHEMBL8916022

SCHEMBL8916022

CC(C)=C(CO)S(=O)(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
TP53 P04637 2/20 0.44
HTT P42858 2/20 0.44
HSD17B10 Q99714 2/20 0.44
PSIP1 O75475 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
KMT2A Q03164 2/20 0.42
NPC1 O15118 1/20 0.42
S1PR2 O95136 1/20 0.42
PRNP P04156 1/20 0.42
XBP1 P17861 1/20 0.42
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.42
ATM Q13315 1/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.41
HTR6 P50406 1/20 0.39
HSD11B1 P28845 2/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27456891 0.84 PSIP1 (0.48) ALDH1A1TP53HTTHSD17B10PSIP1
SCHEMBL8914469 0.78 ALDH1A1 (0.41) ALDH1A1TP53HTTHSD17B10PSIP1
SCHEMBL8914706 0.74 SMN1; SMN2 (0.49) ALDH1A1TP53HTTHSD17B10PSIP1
SCHEMBL9732594 0.74 SMN1; SMN2 (0.48) ALDH1A1TP53HTTHSD17B10PSIP1
SCHEMBL15062217 0.73 SMN1; SMN2 (0.52) ALDH1A1TP53HTTHSD17B10PSIP1
SCHEMBL5469289 0.73 SMN1; SMN2 (0.52) ALDH1A1TP53HTTHSD17B10PSIP1
SCHEMBL3245447 0.72 SMN1; SMN2 (0.53) ALDH1A1TP53HTTHSD17B10PSIP1
SCHEMBL6219403 0.71 PSIP1 (0.52) ALDH1A1TP53HTTHSD17B10PSIP1
SCHEMBL9259483 0.71 SMN1; SMN2 (0.44) ALDH1A1TP53HTTHSD17B10PSIP1
SCHEMBL6627278 0.71 ALDH1A1 (0.44) ALDH1A1TP53HTTHSD17B10PSIP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5510491-A 2-PROPENYL CHLOROFORMATE AND DERIVATIVES AS BLOCKING AGENTS FOR AMINO GROUPS OF PEPTIDES DURING PEPTIDE SYNTHESIS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1996-04-23 US claimed
EP-0401817-B1 Reagents for rapid peptide synthesis RES CORP TECHNOLOGIES INC (US) 1995-09-13 EP claimed
EP-0401817-A2 Reagents for rapid peptide synthesis RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1990-12-12 EP claimed
US-5637719-A PROTECTING PRIMARY OR SECONDARY AMINE RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1997-06-10 US disclosed
US-5510491-A 2-PROPENYL CHLOROFORMATE AND DERIVATIVES AS BLOCKING AGENTS FOR AMINO GROUPS OF PEPTIDES DURING PEPTIDE SYNTHESIS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1996-04-23 US disclosed
EP-0401817-B1 Reagents for rapid peptide synthesis RES CORP TECHNOLOGIES INC (US) 1995-09-13 EP disclosed
EP-0496836-B1 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS RES CORP TECHNOLOGIES INC (US) 1995-06-14 EP disclosed
US-5221754-A Easily removable blocking groups to protect primary or secondary amines RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1993-06-22 US disclosed
EP-0496836-A4 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS 1993-05-05 EP disclosed
EP-0496836-A1 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS. RES CORP TECHNOLOGIES INC (US) 1992-08-05 EP disclosed
WO-1991005564-A1 SYNTHESIS AND USE OF AMINO ACID FLUORIDES AS PEPTIDE COUPLING REAGENTS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1991-05-02 WO disclosed
EP-0401817-A2 Reagents for rapid peptide synthesis RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1990-12-12 EP disclosed